3-bromo-3-isothiocyanatoprop-1-ene
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3-bromo-3-isothiocyanatoprop-1-ene
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CAS No:
101670-62-6
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Formula:
C4H4BrNS
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Chemical Name:
3-bromo-3-isothiocyanatoprop-1-ene
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Synonyms:
ISOTHIOCYANIC ACID,1-BROMOALLYL ESTER; 1-Bromoallylisothiocyanate; 1-Propene,3-bromo-3-isothiocyanato;
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CAS No:
Computed Properties
Molecular Weight:178.05
XLogP3:3.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:176.92478
Monoisotopic Mass:176.92478
Topological Polar Surface Area:44.4
Heavy Atom Count:7
Complexity:106
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 3-bromo-3-isothiocyanatoprop-1-ene
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